[1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate

Systemtic Name: [1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate Openeye Name: [2-(benzylamino)-1-methyl-2-oxo-ethyl] 9-oxobicyclo[3.3.1]nonane-3-carboxylate CAS Name: 9-oxo-3-bicyclo[3.3.1]nonanecarboxylic acid [1-oxo-1-[(phenylmethyl)amino]propan-2-yl] ester IUPAC Name: [1-(benzylamino)-1-oxopropan-2-yl] 9-oxobicyclo[3.3.1]nonane-3-carboxylate Traditional Name: 9-ketobicyclo[3.3.1]nonane-3-carboxylic acid [2-(benzylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)OC(=O)C2CC3CCCC(C2)C3=O

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1)OC(=O)C2CC3CCCC(C2)C3=O

InChI

InChI=1S/C20H25NO4/c1-13(19(23)21-12-14-6-3-2-4-7-14)25-20(24)17-10-15-8-5-9-16(11-17)18(15)22/h2-4,6-7,13,15-17H,5,8-12H2,1H3,(H,21,23)